Base information

Cat. No.
CAS No.87907-02-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C31H34ClN3O12
Molecular Weight 676.068
Exact Mass 675.183
XLogP3 2.40936
Mr 156.061
PSA 184.03
Sequence -
Atom number 81
Bond number 85
Ring number 5
Rotor number 16
Residues number 0
Canonical smiles [N-]=[N+]=N[C@H]1[C@@H]2OC[C@@H](O2)[C@H]([C@@H]1OC(=O)C)O[C@@H]1O[C@H](C(=O)OC)[C@H]([C@@H]([C@H]1OCc1ccccc1)OCc1ccccc1)OC(=O)CCl

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